SCHEMBL28294147

SCHEMBL28294147

CC(=O)O[C@](C(C)=O)(C(=O)C(C)=O)C(O)C(O)C(O)CO

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.32
GAA P10253 1/20 0.32
LMNA P02545 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
USP2 O75604 1/20 0.30
SLCO1B1 Q9Y6L6 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4268176 1.00 PDE4A (0.32) PDE4AGAALMNAL3MBTL1TDP1
SCHEMBL9494454 1.00 PDE4A (0.32) PDE4AGAALMNAL3MBTL1TDP1
SCHEMBL27687926 1.00 PDE4A (0.32) PDE4AGAALMNAL3MBTL1TDP1
SCHEMBL27812014 0.90 GAA (0.33) GAA
SCHEMBL4081023 0.90 GAA (0.33) GAA
SCHEMBL9690679 0.90 GAA (0.33) GAA
SCHEMBL28319261 0.85 GAA (0.31) GAA
SCHEMBL17620598 0.84 PDE4A (0.30) PDE4AGAA
SCHEMBL28082294 0.84 GAA (0.30) GAA
Fluoride Ion SCHEMBL28101087 0.83

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109627270-A A kind of chemical synthesis process of Pseudomonas aeruginosa O11 serotype O antigen oligosaccharides 江南大学 2019-04-16 CN disclosed